7-Amino-1-hydroxymethyl-6-methyl-5,8-isoquinolinedione; N7-Me, O-angeloyl
AlkaPlorer ID: AK011189
Synonym: Cribrostatin 5
IUPAC Name: [6-methyl-7-(methylamino)-5,8-dioxoisoquinolin-1-yl]methyl 2-methylbut-2-enoate
Structure
SMILES: CC=C(C)C(=O)OCC1=C2C(=O)C(NC)=C(C)C(=O)C2=CC=N1
InChI: InChI=1S/C17H18N2O4/c1-5-9(2)17(22)23-8-12-13-11(6-7-19-12)15(20)10(3)14(18-4)16(13)21/h5-7,18H,8H2,1-4H3
InChIKey: BUZBJTWQTFDFES-UHFFFAOYSA-N
Source
| Species | Genus | Family | Order | Class | Phylum | Kingdom | Domain |
|---|---|---|---|---|---|---|---|
| None | Cribrochalina | Niphatidae | Haplosclerida | Demospongiae | Porifera | Metazoa | Eukaryota |
Properties Information
Molecule Weight: 314.341
TPSA？: 85.36
MolLogP？: 1.9634
Number of H-Donors: 1
Number of H-Acceptors: 6
RingCount: 2
Activities Information
| Organism | Target Name | Standard Type | Standard Value | Standard Units | doi |
|---|